4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-[(3-chlorobenzothiophene-2-carbonyl)amino]-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-[(3-chlorobenzothiophene-2-carbonyl)amino]-1-methyl-pyrrole-2-carboxylic acid Formula: C15H11ClN2O3S MolecularWeight: 334.77744

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)O)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CN1C=C(C=C1C(=O)O)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C15H11ClN2O3S/c1-18-7-8(6-10(18)15(20)21)17-14(19)13-12(16)9-4-2-3-5-11(9)22-13/h2-7H,1H3,(H,17,19)(H,20,21)